SCHEMBL30451827

SCHEMBL30451827

Clc1ccc(N2CCOCC2)c(Br)c1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.56
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
AKR1C3 P42330 3/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
PRKDC P78527 1/20 0.50
ALDH3A1 P30838 1/20 0.49
ALDH1A3 P47895 1/20 0.49
ACP1 P24666 2/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
MAPK1 P28482 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24252914 1.00 MAPT (0.56) MAPTSMN1; SMN2GAAAKR1C3NPC1
SCHEMBL30451639 0.83 ALDH1A1 (0.58) MAPTSMN1; SMN2ALDH1A3KMT2AMEN1
SCHEMBL24252459 0.83 ALDH1A1 (0.58) MAPTSMN1; SMN2ALDH1A3KMT2AMEN1
SCHEMBL171808 0.79 MAPT (0.65) MAPTSMN1; SMN2GAARAB9APRKDC
SCHEMBL27885230 0.79 MAPT (0.56) MAPTSMN1; SMN2GAANPC1RAB9A
SCHEMBL2744374 0.79 MAPT (0.67) MAPTSMN1; SMN2GAANPC1RAB9A
SCHEMBL31558342 0.79 KDM4E (0.67) MAPTSMN1; SMN2GAAAKR1C3NPC1
SCHEMBL21588483 0.79 SMN1; SMN2 (0.53) MAPTSMN1; SMN2GAAAKR1C3NPC1
SCHEMBL3724717 0.79 KDM4E (0.67) MAPTSMN1; SMN2GAAAKR1C3NPC1
SCHEMBL17542882 0.77 SMN1; SMN2 (0.43) MAPTSMN1; SMN2AKR1C3NPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 CN disclosed